3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3,5-dimethylphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3,5-dimethylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3,5-dimethylphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(3,5-dimethylphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3,5-dimethylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3,5-dimethylphenyl)benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H25ClN2O3S/c1-15-11-16(2)13-18(12-15)23-21(25)17-7-8-19(22)20(14-17)28(26,27)24-9-5-3-4-6-10-24/h7-8,11-14H,3-6,9-10H2,1-2H3,(H,23,25)